3-[[3-oxidanylidene-2-(oxolan-2-ylmethyl)-1H-isoindol-1-yl]amino]-N-phenethyl-benzamide

Systemtic Name: 3-[[3-oxidanylidene-2-(oxolan-2-ylmethyl)-1H-isoindol-1-yl]amino]-N-phenethyl-benzamide Openeye Name: 3-[[3-oxo-2-(tetrahydrofuran-2-ylmethyl)isoindolin-1-yl]amino]-N-phenethyl-benzamide CAS Name: 3-[[3-oxo-2-(2-oxolanylmethyl)-1H-isoindol-1-yl]amino]-N-phenethylbenzamide IUPAC Name: 3-[[3-oxo-2-(oxolan-2-ylmethyl)-1H-isoindol-1-yl]amino]-N-phenethylbenzamide Traditional Name: 3-[[3-keto-2-(tetrahydrofurfuryl)isoindolin-1-yl]amino]-N-phenethyl-benzamide Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c32-27(29-16-15-20-8-2-1-3-9-20)21-10-6-11-22(18-21)30-26-24-13-4-5-14-25(24)28(33)31(26)19-23-12-7-17-34-23/h1-6,8-11,13-14,18,23,26,30H,7,12,15-17,19H2,(H,29,32)